| SpectraBase Spectrum ID |
1qSTIAczRN5 |
| Name |
2-(5'-Fluorobenzoyl)-1,4-naphthoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
280.053572310 u |
| Formula |
C17H9FO3 |
| InChI |
InChI=1S/C17H9FO3/c18-11-5-3-4-10(8-11)16(20)14-9-15(19)12-6-1-2-7-13(12)17(14)21/h1-9H |
| InChIKey |
NHOABJSHPUCFPB-UHFFFAOYSA-N |
| Molecular Weight |
280.254 g/mol |
| SMILES |
C=1(C(C2=CC=CC=C2C(C1)=O)=O)C(C=1C=C(F)C=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90657 |
